ethyl 4-(3-methyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)piperidine-1-carboxylate

Systemtic Name: ethyl 4-(3-methyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)piperidine-1-carboxylate Openeye Name: ethyl 4-(3-methyl-5-thioxo-1H-1,2,4-triazol-4-yl)piperidine-1-carboxylate CAS Name: 4-(3-methyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-methyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)piperidine-1-carboxylate Traditional Name: 4-(3-methyl-5-thioxo-1H-1,2,4-triazol-4-yl)piperidine-1-carboxylic acid ethyl ester Formula: C11H18N4O2S MolecularWeight: 270.35122

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)N2C(=NNC2=S)C

Isomeric SMILES

CCOC(=O)N1CCC(CC1)N2C(=NNC2=S)C

InChI

InChI=1S/C11H18N4O2S/c1-3-17-11(16)14-6-4-9(5-7-14)15-8(2)12-13-10(15)18/h9H,3-7H2,1-2H3,(H,13,18)